(4-cyclopentyloxy-3-methoxy-phenyl)methyl-(furan-2-ylmethyl)-(pyridin-3-ylmethyl)azanium

Systemtic Name: (4-cyclopentyloxy-3-methoxy-phenyl)methyl-(furan-2-ylmethyl)-(pyridin-3-ylmethyl)azanium Openeye Name: [4-(cyclopentoxy)-3-methoxy-phenyl]methyl-(2-furylmethyl)-(3-pyridylmethyl)ammonium CAS Name: (4-cyclopentyloxy-3-methoxyphenyl)methyl-(2-furanylmethyl)-(3-pyridinylmethyl)ammonium IUPAC Name: (4-cyclopentyloxy-3-methoxyphenyl)methyl-(furan-2-ylmethyl)-(pyridin-3-ylmethyl)azanium Traditional Name: [4-(cyclopentoxy)-3-methoxy-benzyl]-(2-furfuryl)-(3-pyridylmethyl)ammonium Formula: C24H29N2O3+ MolecularWeight: 393.49866

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH+](CC2=CN=CC=C2)CC3=CC=CO3)OC4CCCC4

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH+](CC2=CN=CC=C2)CC3=CC=CO3)OC4CCCC4

InChI

InChI=1S/C24H28N2O3/c1-27-24-14-19(10-11-23(24)29-21-7-2-3-8-21)16-26(18-22-9-5-13-28-22)17-20-6-4-12-25-15-20/h4-6,9-15,21H,2-3,7-8,16-18H2,1H3/p+1